BIM-0010101.P001
TL;DR: BIM-0010101.P001 (CAS 296880-30-3) is a chemical compound with molecular formula C27H22BrFN4O2S and molecular weight 564.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl] 3-(4-bromophenyl)-5-(4-methylphenyl)-3,4-dihydropyrazole-2-carboximidothioate
Also Known As: BIM-0010101.P001, A2002/0084138, 1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl 5-(4-bromophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazole-1-carbimidothioate, [1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl] 3-(4-bromophenyl)-5-(4-methylphenyl)-3,4-dihydropyrazole-2-carboximidothioate, 1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl 5-(4-bromophenyl)-3-(p-tolyl)-4,5-dihydro-1H-pyrazole-1-carbimidothioate
| Molecular Formula | C27H22BrFN4O2S |
|---|---|
| Molecular Weight | 564.06 g/mol |
| LogP | 6.04779 |
| Topological Polar Surface Area | 76.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 564.0631 |
| Heavy Atoms | 36 |
| Complexity | 1360.0309 |
Chemical Identifiers
| CAS Number | 296880-30-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)Br)C(=N)SC4CC(=O)N(C4=O)C5=CC=C(C=C5)F |
Product Overview
BIM-0010101.P001 (CAS 296880-30-3), with molecular formula C27H22BrFN4O2S and molecular weight 564.06 g/mol. IUPAC: [1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl] 3-(4-bromophenyl)-5-(4-methylphenyl)-3,4-dihydropyrazole-2-carboximidothioate.
Chemical Property Profile of BIM-0010101.P001
Property Insights of BIM-0010101.P001
The XLogP value of 6.04779 indicates that BIM-0010101.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.83 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0010101.P001. Following Lipinski's Rule of Five, BIM-0010101.P001 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0010101.P001?
The CAS number of BIM-0010101.P001 is 296880-30-3.
What is the molecular formula of BIM-0010101.P001?
The molecular formula of BIM-0010101.P001 is C27H22BrFN4O2S.
What is the molecular weight of BIM-0010101.P001?
The molecular weight of BIM-0010101.P001 is 564.06 g/mol.
Where can I buy BIM-0010101.P001?
You can request a quote for BIM-0010101.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0010101.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0010101.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.